(3α,5β)-Pregnan-3-yl hydrogen sulfate - pyridine (1:1)

More details:

• Systematic name

  (3alpha,5beta)-Pregnan-3-yl hydrogen sulfate - pyridine (1:1)

• SMILES

  CC[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)OS(=O)(=O)O)C)C.c1ccncc1

• Std. InChi

  InChI=1S/C21H36O4S.C5H5N/c1-4-14-6-8-18-17-7-5-15-13-16(25-26(22,23)24)9-11-21(15,3)19(17)10-12-20(14,18)2;1-2-4-6-5-3-1/h14-19H,4-13H2,1-3H3,(H,22,23,24);1-5H/t14-,15+,16+,17-,18-,19-,20+,21-;/m0./s1

• Std. InChIKey

  ULYYZPXBZRDUFF-FWKNEGEMSA-N

• Cite this record

  CSID:59003052, http://www.chemspider.com/Chemical-Structure.59003052.html (accessed 23:17, Jul 5, 2024)